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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22FN3O6
Molecular Weight 359.3501
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5'-DEOXY-5-FLUORO-N4-(3-METHYL-1-BUTYLOXYCARBONYL)CYTIDINE

SMILES

CC(C)CCOC(=O)NC1=NC(=O)N(C=C1F)[C@@H]2O[C@H](C)[C@@H](O)[C@H]2O

InChI

InChIKey=PPVCPOIDSSQXMR-UORFTKCHSA-N
InChI=1S/C15H22FN3O6/c1-7(2)4-5-24-15(23)18-12-9(16)6-19(14(22)17-12)13-11(21)10(20)8(3)25-13/h6-8,10-11,13,20-21H,4-5H2,1-3H3,(H,17,18,22,23)/t8-,10-,11-,13-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H22FN3O6
Molecular Weight 359.3501
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 11:32:25 UTC 2023
Edited
by admin
on Thu Jul 06 11:32:25 UTC 2023
Record UNII
T83E758HO7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5'-DEOXY-5-FLUORO-N4-(3-METHYL-1-BUTYLOXYCARBONYL)CYTIDINE
Systematic Name English
CARBAMIC ACID, (1-(5-DEOXY-.BETA.-D-RIBOFURANOSYL)-5-FLUORO-1,2-DIHYDRO-2-OXO-4-PYRIMIDINYL)-, 3-METHYLBUTYL ESTER
Common Name English
5'-DEOXY-5-FLUORO-N4-(ISOPENTYLOXYCARBONYL)CYTIDINE
Systematic Name English
CYTIDINE, 5'-DEOXY-5-FLUORO-N-((3-METHYLBUTOXY)CARBONYL)-
Systematic Name English
(5'-DEOXY-5-FLUORO-N4-(3-METHYL-1-BUTYLOXYCARBONYL)CYTIDINE)
Systematic Name English
Code System Code Type Description
FDA UNII
T83E758HO7
Created by admin on Thu Jul 06 11:32:25 UTC 2023 , Edited by admin on Thu Jul 06 11:32:25 UTC 2023
PRIMARY
CAS
162204-30-0
Created by admin on Thu Jul 06 11:32:25 UTC 2023 , Edited by admin on Thu Jul 06 11:32:25 UTC 2023
PRIMARY
EPA CompTox
DTXSID50167334
Created by admin on Thu Jul 06 11:32:25 UTC 2023 , Edited by admin on Thu Jul 06 11:32:25 UTC 2023
PRIMARY
PUBCHEM
54201881
Created by admin on Thu Jul 06 11:32:25 UTC 2023 , Edited by admin on Thu Jul 06 11:32:25 UTC 2023
PRIMARY
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